# generated using pymatgen data_LiCrPO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99378600 _cell_length_b 6.50310503 _cell_length_c 9.71504431 _cell_angle_alpha 109.54515095 _cell_angle_beta 92.77376178 _cell_angle_gamma 98.83385395 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiCrPO4 _chemical_formula_sum 'Li4 Cr4 P4 O16' _cell_volume 350.59236272 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Li Li0 1 0.41814600 0.68512800 0.67557500 1.0 Li Li1 1 0.41002000 0.12692100 0.70551500 1.0 Li Li2 1 0.58185400 0.31487200 0.32442500 1.0 Li Li3 1 0.58998000 0.87307900 0.29448500 1.0 Cr Cr4 1 0.79378800 0.43448200 0.92750400 1.0 Cr Cr5 1 0.01493600 0.62464000 0.27617300 1.0 Cr Cr6 1 0.20621200 0.56551800 0.07249600 1.0 Cr Cr7 1 0.98506400 0.37536000 0.72382700 1.0 P P8 1 0.70823400 0.83003500 0.98627200 1.0 P P9 1 0.29176600 0.16996500 0.01372800 1.0 P P10 1 0.84550300 0.11579600 0.61098800 1.0 P P11 1 0.15449700 0.88420400 0.38901200 1.0 O O12 1 0.09617600 0.07172600 0.66964700 1.0 O O13 1 0.20686700 0.83622200 0.10494400 1.0 O O14 1 0.73040200 0.64184700 0.15163100 1.0 O O15 1 0.28615000 0.19179400 0.30800200 1.0 O O16 1 0.86495600 0.70271000 0.96163400 1.0 O O17 1 0.13504400 0.29729000 0.03836600 1.0 O O18 1 0.19073500 0.69121500 0.55661600 1.0 O O19 1 0.26959800 0.35815300 0.84836900 1.0 O O20 1 0.71385000 0.80820600 0.69199800 1.0 O O21 1 0.79313300 0.16377800 0.89505600 1.0 O O22 1 0.53672800 0.16699900 0.07399000 1.0 O O23 1 0.46327200 0.83300100 0.92601000 1.0 O O24 1 0.80926500 0.30878500 0.44338400 1.0 O O25 1 0.27123200 0.72291700 0.36511900 1.0 O O26 1 0.72876800 0.27708300 0.63488100 1.0 O O27 1 0.90382400 0.92827400 0.33035300 1.0